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SCHEMBL8738667

SCHEMBL8738667

CC(C)c1ccc(C(=O)NC2CC(C)(C)NC(C)(C)C2)cc1

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EZH2 Q15910 8/20 0.67
▸ MEN1 O00255 3/20 0.62
▸ KMT2A Q03164 3/20 0.62
▸ GLA P06280 1/20 0.61
▸ POLB P06746 2/20 0.59
▸ CYP2C9 P11712 1/20 0.57
▸ L3MBTL1 Q9Y468 3/20 0.56
▸ ATM Q13315 1/20 0.54
▸ PKM P14618 1/20 0.53

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL169747 0.89 EZH2 (0.80) EZH2MEN1KMT2AGLAPOLB
SCHEMBL6120669 0.89 EZH2 (0.64) EZH2MEN1KMT2AGLAPOLB
SCHEMBL8739708 0.87 EZH2 (0.72) EZH2MEN1KMT2AGLAPOLB
SCHEMBL17067286 0.85 MEN1 (0.71) EZH2MEN1KMT2AGLAPOLB
SCHEMBL27636094 0.85 EZH2 (0.70) EZH2MEN1KMT2AGLAPOLB
SCHEMBL8738590 0.84 EZH2 (0.72) EZH2MEN1KMT2AGLAPOLB
SCHEMBL6121185 0.84 EZH2 (0.72) EZH2MEN1KMT2AGLAPOLB
SCHEMBL14679120 0.84 POLB (0.73) EZH2MEN1KMT2AGLAPOLB
SCHEMBL6120701 0.82 EZH2 (0.70) EZH2MEN1KMT2AGLAPOLB
SCHEMBL13683724 0.82 EZH2 (0.70) EZH2MEN1KMT2AGLAPOLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012068589-A2 MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF CONSTELLATION PHARMACEUTICALS (US) 2012-05-24 — — WO disclosed